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17:30 |
MM 12.1 |
Molecular dynamics studies on amorphous CuTi nanoparticles — •Susanne Fichtner and S.G. Mayr
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17:30 |
MM 12.2 |
Nonlinear effects of damping behavior and activation volume of metallic glasses below to above the glass transition temperature — •Moritz Schwabe, Dennis Bedorf, and Konrad Samwer
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17:30 |
MM 12.3 |
Combined in-situ SAXS/WAXS and HRTEM Study on Crystallization of (Cu60Co40)1−xZrx Metallic Glasses — •B. Schwarz, U. Vainio, N. Mattern, S.W. Sohn, D. H. Kim, and J. Eckert
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17:30 |
MM 12.4 |
Combined in-situ SAXS/WAXS and HRTEM Study on Crystallization of (Cu60Co40)1−xZrx Metallic Glasses — •B. Schwarz, U. Vainio, N. Mattern, S.W. Sohn, D. H. Kim, and J. Eckert
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17:30 |
MM 12.5 |
Combined in-situ SAXS/WAXS and HRTEM Study on Crystallization of (Cu60Co40)1−xZrx Metallic Glasses — •B. Schwarz, U. Vainio, N. Mattern, S.W. Sohn, D.H. Kim, and J. Eckert
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17:30 |
MM 12.6 |
Investigation of the viscosity for Bi-Sn(Zn) liquid alloys — •Andriy Yakymovych, Oleg Volkov, and Petro Yakibchuk
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17:30 |
MM 12.7 |
Vitreous tantalum oxide films on glassy tantalum thin film — •Michael Scheele, Kevin Stella, and Detlef Diesing
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17:30 |
MM 12.8 |
Interfacial tension and wetting at the liquid-liquid interface in Al-Bi, Al-In and Al-Pb monotectic alloys — •Ivan Kaban, Markus Köhler, Lorenz Ratke, Walter Hoyer, Norbert Mattern, and Jürgen Eckert
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17:30 |
MM 12.9 |
Investigation of Real Space Orbital Free Density Functional Theory for the Study of Large Systems — •Jade Mackay, Rainer Backofen, and Axel Voigt
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17:30 |
MM 12.10 |
Generation of polarizable force fields for molecular dynamics simulations of metal oxide systems with long-range interactions — •Philipp Beck, Peter Brommer, and Hans-Rainer Trebin
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17:30 |
MM 12.11 |
Frozen phonon calculations confirm electron-phonon coupling in Fe1−xCoxSi — •Wilfried Wunderlich and Dirk Menzel
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17:30 |
MM 12.12 |
Ab initio calculation of variable saddle point energies for atom jumps in L12 ordered Ni3Al — •Martin Leitner, Doris Vogtenhuber, Raimund Podloucky, Wolfgang Pfeiler, and Wolfgang Püschl
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17:30 |
MM 12.13 |
FeN4 defects in carbon nanostructures: a comparative study with Fe-porphyrin and Fe-phthalocyanine molecules. — •Ingrid Ibagon and Hélio Chacham
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17:30 |
MM 12.14 |
Preliminary theoretical results on the solubility of ZnO — •Svea Sauer, Susan Köppen, Lucio Colombi Ciacchi, Christof Köhler, and Thomas Frauenheim
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17:30 |
MM 12.15 |
Structures of metal electrodes at the solid-liquid interface studied by density functional theory — •Xiaohang Lin
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17:30 |
MM 12.16 |
A variable charge transfer model for the molecular dynamics code IMD — •Andreas Chatzopoulos and Hans-Rainer Trebin
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17:30 |
MM 12.17 |
Modellierung digitaler Kornmikrostrukturen — •Stefan Schäfer und Dana Zöllner
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17:30 |
MM 12.18 |
Cluster Expansion study of FexNiyAl1−x−y alloys — •Georg Kastlunger, David Reith, Markus Stöhr, and Raimund Podloucky
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17:30 |
MM 12.19 |
Molecular dynamics simulations of tensile tests in Al2O3 with new polarizable force field — •Stephen Hocker, Philipp Beck, Siegfried Schmauder, and Hans-Rainer Trebin
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17:30 |
MM 12.20 |
Phonon Contribution to the Thermodynamics of Pure and Mixed Clusters in bcc-Fe — •Mina Talati, Matthias Posselt, Giovanni Bonny, Ahmed Tamer Al-Motasem, and Frank Bergner
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17:30 |
MM 12.21 |
Electronic Structure of the Doped fcc- C60 Compound of Solid fcc-C60: Ab Initio Calculations — •Samaneh Javanbakht and Saied Jalali Asadabadi
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17:30 |
MM 12.22 |
Extending the Cluster Expansion by vibrational free energies — •David Reith, Markus Stöhr, and Raimund Podloucky
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17:30 |
MM 12.23 |
Molecular dynamics simulations of femtosecond laser ablation in copper — •Carolina Trichet Paredes, Steffen Sonntag, Johannes Roth, and Hans-Rainer Trebin
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17:30 |
MM 12.24 |
Heat capacity of aluminum nitride phases from ab initio calculations — •Steve Schmerler and Jens Kortus
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17:30 |
MM 12.25 |
Density functional theory study of LO-TO splitting of vibrational modes of insulating compounds — •Marcel Hieckel, David Reith, and Raimund Podloucky
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17:30 |
MM 12.26 |
Comparative analysis of hydrogen-vacancy interactions in Mg and Al based on density functional theory — •Lars Ismer, Min Sik Park, Anderson Janotti, and Chris G Van de Walle
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17:30 |
MM 12.27 |
LAMMPSCUDA - A general purpose MD code — •Christian Trott and Lars Winterfeld
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17:30 |
MM 12.28 |
Construction of High-Dimensional Neural Network Potentials Based on Atomic Pairs — •Jovan Jose Kochumannil Varghese and Jörg Behler
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17:30 |
MM 12.29 |
The solubility of carbon in bcc iron under volumetric strain: comparison of DFT and empirical methods — Elisaveta Hristova, •Rebecca Janisch, and Alexander Hartmaier
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17:30 |
MM 12.30 |
Efficient ab-initio characterisation of the parameter space of grain boundaries — Naveed Ahmed, Xueyong Pang, Christian Kellermann, •Rebecca Janisch, Holger Dette, and Alexander Hartmaier
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17:30 |
MM 12.31 |
Molecular Dynamics Simulations on Carbon Nanoclusters — •Andrew Aird and Jörg Wrachtrup
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17:30 |
MM 12.32 |
(contribution withdrawn) Quantitative study of the effect of local ordering on the growth kinetics of metallic alloys — M. Guerdane, B. Nestler, and •H. Teichler
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17:30 |
MM 12.33 |
A study of ice crystal growth based on diffuse interface modeling using extended anisotropy formulations — •Marcel Huber, Frank Wendler, and Britta Nestler
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17:30 |
MM 12.34 |
Phocphate Crystallisation — •Paul Schneider, Andreas Erbe, and Frank Renner
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17:30 |
MM 12.35 |
Impact of Ni on degradation of 8.5 mol% Y2O3-doped ZrO2 (8YDZ) — •Benjamin Butz, Andreas Lefarth, Heike Störmer, Annika Utz, and Dagmar Gerthsen
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17:30 |
MM 12.36 |
Theoretical and experimental structure analysis of the (1 0 -1 -1) ZnO twin boundary — •Viktor Hrkac, Viola Duppel, Yogendra Kumar Mishra, Rainer Adelung, and Lorenz Kienle
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17:30 |
MM 12.37 |
Characterization of Complex Structures by means of Precession Electron Diffraction — Ulrich Schürmann, Viola Duppel, Saskia Buller, Wolfgang Bensch, and •Lorenz Kienle
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17:30 |
MM 12.38 |
Transmission Electron Microscopy Studies along the Process Chain of Printable Electronics based on Nanoparticulate Systems — •Stefanie Spallek, Benjamin Butz, and Erdmann Spiecker
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17:30 |
MM 12.39 |
Characterization of ex-situ heated Fe70Pd30 thick films using TEM and STEM techniques — •Andriy Lotnyk, Christoph Bechtold, Burak Erkartal, Lorenz Kienle, and Eckhard Quandt
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17:30 |
MM 12.40 |
Structural analysis of severly deformed Ni3Ge — •Andreas Grill, Hans-Peter Karnthaler, and Christian Rentenberger
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17:30 |
MM 12.41 |
3D imaging and characterisation of strengthening particles in Inconel 718 using FIB tomography — •Adam Kruk, Adam Gruszczyński, and Aleksandra Czyrska-Filemonowicz
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17:30 |
MM 12.42 |
Analytical transmission electron microscopy investigations of Sn-Pd nanoparticals with core-shell structures — •Dietrich Haeussler, Bernhard Schaffer, Fu Liu, Ferdinand Hofer, X. B. Zhang, and Wolfgang Jaeger
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17:30 |
MM 12.43 |
Interface studies on carbon nanotubes grown from Fe20Ni80 catalysts particles — •Anja Kießling, Darius Pohl, Christine Täschner, Mark Herrmann Rümmeli, Ludwig Schultz, and Bernd Rellinghaus
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17:30 |
MM 12.44 |
Characterization of Al-Si alloy - TiB2 particles composite structure by STEM — •Justyna Grzonka, Tomasz Plocinski, Pedro Egizabal, and Krzysztof Kurzydlowski
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17:30 |
MM 12.45 |
Characterization of Al-Si alloy - TiB2 particles composite structure by STEM — •Tomasz Plocinski, Justyna Grzonka, Pedro Egizabal, and Krzysztof Kurzydlowski
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17:30 |
MM 12.46 |
TEM diffraction used for 3D profile analysis of nanomaterials — •Christoph Gammer, Clemens Mangler, Hans-Peter Karnthaler, and Christian Rentenberger
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17:30 |
MM 12.47 |
Growth of nanosized ordered domains in nanocrystalline intermetallic FeAl studied by TEM methods — •Christoph Gammer, Clemens Mangler, Hans-Peter Karnthaler, and Christian Rentenberger
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17:30 |
MM 12.48 |
A Method to Locally Determine Layer Dimensions and Interface Roughness for Multilayer Coatings with Ultimate Accuracy — •Dietrich Häußler, Ulrich Roß, Uwe Heidorn, Frank Hertlein, Jörg Wiesmann, and Wolfgang Jäger
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17:30 |
MM 12.49 |
Electron holography of Fe nanoparticles embedded in MgO crystals — •Dorin Geiger, Hannes Lichte, Artem Shalimov, and Kay Potzger
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17:30 |
MM 12.50 |
In-situ TEM investigation under extreme heat: Gold and hydrocarbon adsorbates on graphene — •Benedikt Westenfelder, Jannik C. Meyer, Xiaohang Lin, Ferdinand Scholz, Carl E. Krill III, Axel Groß, and Ute Kaiser
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17:30 |
MM 12.51 |
High Resolution Transmission Electron Microscopy of Organic Molecules on Graphene — •Gerardo Algara-Siller, Goutam Pramanik, Tanja Weil, and Ute Kaiser
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17:30 |
MM 12.52 |
Influence of chemical bonding on HRTEM images of light elements — •Simon Kurasch, Jannik C. Meyer, Hye Jin Park, Viera Skakalova, Siegmar Roth, and Ute Kaiser
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17:30 |
MM 12.53 |
The Unitarily Covariant Formulation of Hedin’s Equations — •Ronald Starke and Georg Kresse
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